SCHEMBL5738702

SCHEMBL5738702

CCc1ccc(CCOc2ccc(CC(NC(C)=O)C(=O)O)cc2)nc1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.65
ITGB3 P05106 14/20 0.59
ITGA2B P08514 3/20 0.59
ITGB1 P05556 13/20 0.53
ITGA5 P08648 13/20 0.53
ITGAV P06756 11/20 0.53
CYP3A4 P08684 1/20 0.48
RXRA P19793 1/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5769759 0.89 PPARG (0.55) PPARGITGB3ITGA2BITGB1ITGA5
SCHEMBL13475126 0.89 PPARG (0.69) PPARGITGB3ITGA2BITGB1ITGA5
SCHEMBL5738689 0.88 PPARG (0.54) PPARGITGB3ITGA2BITGB1ITGA5
SCHEMBL4874828 0.84 PPARG (0.58) PPARGITGB3ITGA2BITGB1ITGA5
Hydrochloric Acid SCHEMBL5738405 0.83 PPARG (0.57) PPARGITGB3ITGA2BITGB1ITGA5
SCHEMBL3313236 0.82 PPARG (0.58) PPARGITGB3ITGB1ITGA5ITGAV
SCHEMBL13742843 0.81 PPARG (0.54) PPARGITGB3ITGB1ITGA5ITGAV
SCHEMBL21422518 0.80 PPARG (0.52) PPARGITGB3ITGAVCYP3A4RXRA
SCHEMBL2332479 0.80 PPARA (0.61) PPARG
SCHEMBL2361274 0.80 PPARA (0.61) PPARG

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1622898-A1 PROCESSES FOR MAKING THIAZOLIDINEDIONE DERIVATIVES AND COMPOUNDS THEREOF Synthon B.V. (NL) 2006-02-08 EP disclosed
US-20050059708-A1 Processes for making thiazolidinedione derivatives and compounds thereof SYNTHON BV (NL) 2005-03-17 US disclosed
WO-2004101560-A1 PROCESSES FOR MAKING THIAZOLIDINEDIONE DERIVATIVES AND COMPOUNDS THEREOF SYNTHON B.V. (NL) 2004-11-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050059708-A1 Processes for making thiazolidinedione derivatives and compounds thereof PPARD, PPARG, PPARA PPARG 2/4885ITGB3 2321/4885ITGA2B 3532/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.